Mrv1652309201719022D          

  6  5  0  0  0  0            999 V2000
    0.8250    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0625    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  6  3  1  0  0  0  0
M  END
> <DATABASE_ID>
DB04398

> <DATABASE_NAME>
drugbank

> <SMILES>
CC(O)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)

> <INCHI_KEY>
JVTAAEKCZFNVCJ-UHFFFAOYSA-N

> <FORMULA>
C3H6O3

> <MOLECULAR_WEIGHT>
90.0779

> <EXACT_MASS>
90.031694058

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
12

> <JCHEM_AVERAGE_POLARIZABILITY>
8.051819865737073

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-hydroxypropanoic acid

> <ALOGPS_LOGP>
-0.79

> <JCHEM_LOGP>
-0.47182951800000017

> <ALOGPS_LOGS>
0.79

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
14.593508084825753

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.784942414122652

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6696493832413326

> <JCHEM_POLAR_SURFACE_AREA>
57.53

> <JCHEM_REFRACTIVITY>
18.8398

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
5.62e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
lactic acid

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB04398

> <SECONDARY_ACCESSION_NUMBERS>
EXPT01996; DB09294

> <DRUG_GROUPS>
approved; vet_approved

> <GENERIC_NAME>
Lactic acid

> <SYNONYMS>
(±)-2-hydroxypropanoic acid; 2-Hydroxypropanoic acid; 2-Hydroxypropionic acid; ácido láctico; Acidum lacticum; DL- lactic acid; DL-Lactic Acid; DL-Milchsäure; Lactic acid; Lacticum acidum; Milchsäure; Milk acid; rac-lactic acid; α-hydroxypropanoic acid; α-hydroxypropionic acid

> <PRODUCTS>
(40 Mmols/l) Potassium Chloride In Lactated Ringer's Injection USP; 5% Dextrose In Lactated Ringer's Injection; AnubisMed; Balance 1.5% Glucose, 1.25 Mmol/l Calcium; Balance 1.5% Glucose, 1.75 Mmol/l Calcium; Balance 2.3% Glucose, 1.25 Mmol/l Calcium; Balance 2.3% Glucose, 1.75 Mmol/l Calcium; Balance 4.25% Glucose, 1.25 Mmol/l Calcium; Balance 4.25% Glucose, 1.75 Mmol/l Calcium; Caneal Peritoneal Dialysis Solution; Cheongin Haejanghwan; Cheongin Haewoohwan; Cheongin Samrakhwan; Cluederm Aqua Solution Peel Plus; Cuplex Gel; Curel Alpha Hydroxy Dry Skin Lotion; DIANEAL Low Calcium Peritoneal Dialysis Solution with Dextrose; DIANEAL Low Calcium with Dextrose; DIANEAL PD-1 with Dextrose; DIANEAL PD-2 Peritoneal Dialysis Solution with Dextrose; DIANEAL PD-2 with Dextrose; Delflex; Delflex A Perit.dial.solN.W.1.5%dext.low mg; Delflex A Perit.dial.solN.W.2.5%dext.low mg; Delflex A Perit.dial.soln W.4.25%dext.low mg; Delflex A Periton.dial.solN.W.1.5% Dextrose; Delflex A Periton.dial.solN.W.4.25% Dextrose; Delflex A Periton.dial.soln. W.2.5% Dextrose; Delflex Perit.dial.soL.1.5%dex.low Ca Low mg; Delflex Perit.dial.soL.2.5%dex.low Ca Low mg; Delflex Perit.dial.soL.4.25%dex.low Calow mg; Delflex Peritoneal Dialysis Solution With 0.5% Dextrose; Dextrose 2.5% In Half Strength Lactated Ringer's Injection, USP; Dextrose 5% and Electrolyte No75 Inj; Dextrose and Electrolyte No. 48; Dextrose and Electrolyte No. 75; Dextrose in Lactated Ringers; Dianeal Pd 101 Capd Solution W 0.5% Dextrose; Dianeal Pd 101 Capd Solution W 1.5% Dextrose; Dianeal Pd 101 Capd Solution W 2.5% Dextrose; Dianeal Pd 101 Capd Solution W 4.25% Dextrose; Dianeal Pd 102 Capd Solution W 1.5% Dextrose; Dianeal Pd 102 Capd Solution W 4.25% Dextrose; Dianeal Pd 104 Capd Solution W 0.5% Dextrose; Dianeal Pd109 Capd Solution; Dianeal Pd4 Capd Solution With 1.5% Dextrose and 2.5meq/l Calcium; Dianeal Pd4 Capd Solution With 2.5% Dextrose and 2.5meq/l Calcium; Dianeal Pd4 Capd Solution With 4.25% Dextrose and 2.5meq/l Calcium; Dianeal for Peritoneal Dialysis; Extraneal; Fresh Morning Bifidus bifidus; Glycerolyte 57 Solution; Glysol-500; Hemosol Lg2; Hemosol Lg4; Hemosol Lo; Herbal Stemcell Aha Peel; Inpersol Lc With Dextrose 1.5% Liq; Inpersol Lc With Dextrose 2.5% Liq; Inpersol Lc With Dextrose 4.25% Liq; Inpersol Lm W 1.5% Dextrose; Inpersol Lm W 2.5% Dextrose; Inpersol Lm W 4.25% Dextrose; Inpersol W Dextrose 1.5%; Inpersol W Dextrose 2.5%; Inpersol W Dextrose 4.25% Inj; Inpersol With Dextrose 0.5%; Ionosol B and Dextrose; Ionosol MB and Dextrose; Jayjun Gold Snow Refreshing Peeling; Keri Fast Absorbing - Aha - Lot 5%; Keri Original - Aha - Lotion 5%; Kimchi Vitamin chewable multivitamin; Lacellate Solution - 1000; Lacellate Solution - 250; Lacellate Solution - 500; Lactate 1-2-3 Injection; Lactate Chloride Dextrose Inj; Lactated Ringer's Injection; Lactated Ringer's Injection USP; Lactated Ringer's Injection, USP; Lactated Ringer's Irrigation; Lactated Ringer's Irrigation Sol; Lactated Ringer's and 5% Dextrose; Lactated Ringer's and 5% Injection, USP; Lactated Ringers; Lactated Ringers Irrigation; Lactated Ringers and Dextrose; Lactic Acid; Lactic Acid 10% / Niacinamide 4%; Lactic Acid 10% / Urea 40%; Lactic Acid 30% / Salicylic Acid 30%; Lacticare Lot; Lactimol - Crm 10%; Lactinol; Lactinol-E; Nutrineal Pd4; Nxstage Pureflow Dialysate Concentrate (sak 303); Nxstage Pureflow Dialysate Concentrate (sak 304); Nxstage Pureflow Dialysate Concentrate (sak 305); Nxstage Pureflow Dialysate Concentrate (sak-301); Nxstage Pureflow Dialysate Concentrate (sak-302); Nxstage Pureflow Solution Rfp-204-can; Nxstage Pureflow Solution Rfp-207-can; Nxstage Pureflow Solution Rfp-209-can; PRENATE Restore; Penederm Cream; Penederm Lotion; Physioneal 40 Glucose 1.36% W/V 13.6mg/ml Clear-flex; Physioneal 40 Glucose 1.36% W/V 13.6mg/ml Solution for Peritoneal Dialysis; Physioneal 40 Glucose 2.27% W/V 22.7 mg/ml Clear-flex; Physioneal 40 Glucose 2.27% W/V 22.7 mg/ml, Solution for Peritoneal Dialysis; Physioneal 40 Glucose 3.86% W/V 38.6 mg/ml Clear-flex; Physioneal 40 Glucose 3.86% W/V 38.6mg/ml, Solution for Peritoneal Dialysis; Plasma-Lyte M and Dextrose; Plasma-Lyte R; Potas Chlor 20meq 5% Dex and Lactate Ringer; Potassium Chlor 40meq 5% Dex & Lac Ring; Potassium Chloride In Lactated Ringer's Injection; Potassium Chloride and Dextrose; Potassium Chloride in Lactated Ringers and Dextrose; Prism0cal; PrismaSol; Prismasol 0; Prismasol 4; Prismasol B22gk4/0; Prismasol Bgk0/2.5; Prismasol Bgk2/0; Prismasol Bgk2/3.5; Prismasol Bgk4/0/1.2; Prismasol Bgk4/2.5; Prismasol Bgk4/3.5; Prismasol Bk0/0/1.2; Ringers; Selutrio 10; Selutrio 40; Sodium Lactate; Spot Care Blue One; Ti-U-lac Lotion; Tiacid Solution; YOUNGCELLOGY AIOS LV Serum; Yenaya Secret Gung Cleanser

> <SALTS>
Sodium lactate

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